SCHEMBL1140183

SCHEMBL1140183

COc1ccc(CNc2cc(Oc3ccc(C(C(N)=O)C(=O)Nc4ccc(F)cc4)cc3F)ncn2)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 4/20 0.53
MAP2K7 O14733 10/20 0.50
MET P08581 3/20 0.43
KDR P35968 2/20 0.43
MAPK3 P27361 1/20 0.42
HDAC1 Q13547 1/20 0.41
KLK7 P49862 2/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1136843 0.86 MET (0.56) METKDR
SCHEMBL1140184 0.84 RAF1 (0.64) RAF1MAP2K7METKDRMAPK3
SCHEMBL1136762 0.84 RAF1 (0.60) RAF1MAP2K7METKDRMAPK3
SCHEMBL1137337 0.81 EGFR (0.47) RAF1METKDR
SCHEMBL1136789 0.80 RAF1 (0.63) RAF1MAP2K7METMAPK3
SCHEMBL2256662 0.80 MET (0.62) RAF1METKDRMAPK3HDAC1
SCHEMBL1137006 0.80 MET (0.50) RAF1METKDRMAPK3HDAC1
SCHEMBL1137042 0.79 MET (0.48) METKDR
SCHEMBL1137054 0.77 RAF1 (0.51) RAF1MAP2K7MAPK3HDAC1
SCHEMBL13998787 0.75 MAP2K7 (0.52) RAF1MAP2K7METKDRMAPK3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989477-B2 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2011-08-02 US disclosed
EP-1737451-B1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-02-23 EP disclosed
US-20100183606-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-07-22 US disclosed
US-7714138-B2 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-05-11 US disclosed
US-20090054436-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2009-02-26 US disclosed
US-7459562-B2 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-12-02 US disclosed
US-20050245530-A1 Monocyclic heterocycles as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2005-11-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090054436-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS CDK2, MAP3K19, CDK1 RAF1 142/4885MAP2K7 60/4885MET 162/4885
US-20050245530-A1 Monocyclic heterocycles as kinase inhibitors CDK2, MAP3K19, CDK1 RAF1 142/4885MAP2K7 60/4885MET 162/4885
US-20100183606-A1 MONOCYCLIC HETEROCYCLES AS KINASE INHIBITORS CDK2, MAP3K19, CDK1 RAF1 142/4885MAP2K7 60/4885MET 162/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.